7-(4-dimethylphosphorylbutyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-(4-dimethylphosphorylbutyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-(4-dimethylphosphorylbutyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(4-dimethylphosphorylbutyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(4-dimethylphosphorylbutyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(4-dimethylphosphorylbutyl)-1,3-dimethyl-xanthine Formula: C13H21N4O3P MolecularWeight: 312.304601

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCCP(=O)(C)C

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCCP(=O)(C)C

InChI

InChI=1S/C13H21N4O3P/c1-15-11-10(12(18)16(2)13(15)19)17(9-14-11)7-5-6-8-21(3,4)20/h9H,5-8H2,1-4H3